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About This Item
Empirical Formula (Hill Notation):
C5H8O3
CAS Number:
Molecular Weight:
116.12
PubChem Substance ID:
UNSPSC Code:
12352100
Beilstein/REAXYS Number:
109671
MDL number:
grade
purum
refractive index
n20/D 1.46 (lit.), n20/D 1.461
bp
128-129 °C/13 mmHg (lit.), 237-243 °C (lit.)
density
1.209 g/mL at 25 °C (lit.)
SMILES string
OC(=O)C1CCCO1
InChI
1S/C5H8O3/c6-5(7)4-2-1-3-8-4/h4H,1-3H2,(H,6,7)
InChI key
UJJLJRQIPMGXEZ-UHFFFAOYSA-N
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S Bando et al.
Acta crystallographica. Section C, Crystal structure communications, 46 ( Pt 1), 106-108 (1990-01-15)
C5H10O4, Mr = 134.31, monoclinic, P2(1), a = 11.670 (2), b = 6.177 (3), c = 10.704 (2) A, beta = 115.11 (2) degrees, V = 698.7 (4) A3, Z = 4, Dm = 1.26, Dx = 1.28 g cm-3
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